1-[4-(hexadecylamino)phenyl]-2-methylsulfonyl-ethanone

Systemtic Name: 1-[4-(hexadecylamino)phenyl]-2-methylsulfonyl-ethanone Openeye Name: 1-[4-(hexadecylamino)phenyl]-2-methylsulfonyl-ethanone CAS Name: 1-[4-(hexadecylamino)phenyl]-2-methylsulfonylethanone IUPAC Name: 1-[4-(hexadecylamino)phenyl]-2-methylsulfonylethanone Traditional Name: 1-[4-(cetylamino)phenyl]-2-mesyl-ethanone Formula: C25H43NO3S MolecularWeight: 437.67882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)CS(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)CS(=O)(=O)C

InChI

InChI=1S/C25H43NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-26-24-19-17-23(18-20-24)25(27)22-30(2,28)29/h17-20,26H,3-16,21-22H2,1-2H3